CID 2783607

6-chloro-2-methyl-2,3-dihydropyridazin-3-one

Structural Information

Molecular Formula
C5H5ClN2O
SMILES
CN1C(=O)C=CC(=N1)Cl
InChI
InChI=1S/C5H5ClN2O/c1-8-5(9)3-2-4(6)7-8/h2-3H,1H3
InChIKey
IMBNTYIRTCQBRJ-UHFFFAOYSA-N
Compound name
6-chloro-2-methylpyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

269
Patents

144.00903 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.016306 121.3
[M+Na]+ 166.998248 133.4
[M-H]- 143.001754 123.0
[M+NH4]+ 162.042853 141.5
[M+K]+ 182.972188 130.3
[M+H-H2O]+ 127.006290 115.6
[M+HCOO]- 189.007231 140.3
[M+CH3COO]- 203.022881 172.0
[M+Na-2H]- 164.983696 129.9
[M]+ 144.00848142 124.1
[M]- 144.00957858 124.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe